| Record Information | 
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| HMDB Status | Not Available | 
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| Creation Date | 2024-02-20 23:52:40 UTC | 
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| Update Date | 2025-03-21 18:03:33 UTC | 
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| HMDB ID | Not Available | 
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| Metabolite Identification | 
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| DeepMet ID | DMID00044985 | 
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| Frequency | 75.0 | 
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| Structure |  | 
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| Chemical Formula | C12H24 | 
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| Molecular Mass | 168.1878 | 
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| SMILES | CC(C)=CC(C)CCCC(C)C | 
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| InChI Key | YDGADXSIZMCRMB-UHFFFAOYSA-N | 
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| Chemical Taxonomy | 
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| Kingdom | organic compounds | 
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| Superclass | hydrocarbons | 
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| Class | unsaturated hydrocarbons | 
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| Subclass  | branched unsaturated hydrocarbons | 
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| Direct Parent  | branched unsaturated hydrocarbons | 
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| Geometric Descriptor  | aliphatic acyclic compounds | 
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| Alternative Parents  | alkenesunsaturated aliphatic hydrocarbons | 
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| Substituents  | aliphatic acyclic compoundbranched unsaturated hydrocarbonalkeneunsaturated aliphatic hydrocarbonolefinacyclic olefin | 
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